Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "19c3c7645c24fc6cb4ca661fbfa6c6fb",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 117.83,
"b": 117.83,
"c": 154.93,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92013],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.650,2.550],
"number_observations": 855062,
"number_observations_unique": 41128,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "R(meas)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 18.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.650,2.550],
"number_observations": 99737,
"number_observations_unique": 4581,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.853
},
{
"type": "R(meas)",
"value": 1.897
},
{
"type": "R(pim)",
"value": 0.406
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.800
},
{
"type": "CC(1/2)",
"value": 0.714
}
]
},
{
"resolution_limits": [29.650,9.190],
"number_observations": 18349,
"number_observations_unique": 948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 52.500
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 19.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}